Name: Name:3-{[(9H-fluoren-9-ylmethoxy)carbonyl][(4-fluorophenyl)methyl]amino}propanoic acid
Brand: Angene
SKU: AG01EKC3
Rating: 90 (10 reviews)

3-{[(9H-fluoren-9-ylmethoxy)carbonyl][(4-fluorophenyl)methyl]amino}propanoic acid

CAS No.:

2137695-93-1

Catalog Number:

AG01EKC3

Molecular Formula:

C25H22FNO4

Molecular Weight:

419.4449

Catalog Number:

AG01EKC3

Chemical Name:

3-{[(9H-fluoren-9-ylmethoxy)carbonyl][(4-fluorophenyl)methyl]amino}propanoic acid

CAS Number:

2137695-93-1

Molecular Formula:

C25H22FNO4

Molecular Weight:

419.4449

MDL Number:

MFCD31584532

IUPAC Name:

3-[9H-fluoren-9-ylmethoxycarbonyl-[(4-fluorophenyl)methyl]amino]propanoic acid

InChI:

InChI=1S/C25H22FNO4/c26-18-11-9-17(10-12-18)15-27(14-13-24(28)29)25(30)31-16-23-21-7-3-1-5-19(21)20-6-2-4-8-22(20)23/h1-12,23H,13-16H2,(H,28,29)

InChI Key:

RCUZWRPHGFCVAI-UHFFFAOYSA-N

SMILES:

OC(=O)CCN(C(=O)OCC1c2ccccc2c2c1cccc2)Cc1ccc(cc1)F

Complexity:

599

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

419.153g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

419.452g/mol

Monoisotopic Mass:

419.153g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

66.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

4.3